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304859-21-0

304859-21-0 | 3-Piperidinecarboxylic acid, 6-oxo-1-(phenylmethyl)-, ethyl ester

CAS No: 304859-21-0 Catalog No: AG0030AQ MDL No:MFCD23135846

Product Description

Catalog Number:
AG0030AQ
Chemical Name:
3-Piperidinecarboxylic acid, 6-oxo-1-(phenylmethyl)-, ethyl ester
CAS Number:
304859-21-0
Molecular Formula:
C15H19NO3
Molecular Weight:
261.3163
MDL Number:
MFCD23135846
IUPAC Name:
ethyl 1-benzyl-6-oxopiperidine-3-carboxylate
InChI:
InChI=1S/C15H19NO3/c1-2-19-15(18)13-8-9-14(17)16(11-13)10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3
InChI Key:
JBMXVMVVSOFZEM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCC(=O)N(C1)Cc1ccccc1

Properties

Complexity:
323  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.136g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.321g/mol
Monoisotopic Mass:
261.136g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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